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SMILES: C(C(O)C(=O)O)(O)C(=O)O.[C@]12([C@H]3C(=CC(C1)CN3CCc1c2[nH]c2c1cccc2)CC)C(=O)OC Canonical SMILES: OC(=O)C(C(C(=O)O)O)O.CCC1=CC2CN3[C@H]1[C@@](C2)(C(=O)OC)c1[nH]c2c(c1CC3)cccc2 InChI: InChI=1S/C21H24N2O2.C4H6O6/c1-3-14-10-13-11-21(20(24)25-2)18-16(8-9-23(12-13)19(14)21)15-6-4-5-7-17(15)22-18;5-1(3(7)8)2(6)4(9)10/h4-7,10,13,19,22H,3,8-9,11-12H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10)/t13?,19-,21+;/m1./s1 InChIKey: JYBKPXVXYJDIFX-SADKPMMYSA-N
CBID:163857 http://www.chembase.cn/molecule-163857.html